methyl 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoate

Systemtic Name: methyl 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butanoate Openeye Name: methyl 3-(1-methyltetrazol-5-yl)sulfanylbutanoate CAS Name: 3-[(1-methyl-5-tetrazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl 3-(1-methyltetrazol-5-yl)sulfanylbutanoate Traditional Name: 3-[(1-methyltetrazol-5-yl)thio]butyric acid methyl ester Formula: C7H12N4O2S MolecularWeight: 216.26078

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)SC1=NN=NN1C

Isomeric SMILES

CC(CC(=O)OC)SC1=NN=NN1C

InChI

InChI=1S/C7H12N4O2S/c1-5(4-6(12)13-3)14-7-8-9-10-11(7)2/h5H,4H2,1-3H3